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Implementation of ProLIF#179

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talagayev merged 20 commits intowolberlab:mainfrom
talagayev:prolif_implementation
Jan 26, 2026
Merged

Implementation of ProLIF#179
talagayev merged 20 commits intowolberlab:mainfrom
talagayev:prolif_implementation

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@talagayev talagayev commented Jan 26, 2026

Addition of new option for interaction calculation. Currently it is only PLIP that is used and now ProLIF will be used as well.

Changes made:

  • Addition of ProLIF as an alternative option for interaction calculation

PR Checklist

  • Issue raised/referenced?
  • Tests updated/added?
  • Documentation updated/added?
  • CHANGELOG file updated?
  • Is your name in AUTHORS?

@talagayev talagayev merged commit ae2814b into wolberlab:main Jan 26, 2026
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